4-[[(5S)-5-ethoxycarbonyl-5-methyl-2-oxidanylidene-1-phenyl-pyrrol-3-yl]amino]benzoate

Systemtic Name: 4-[[(5S)-5-ethoxycarbonyl-5-methyl-2-oxidanylidene-1-phenyl-pyrrol-3-yl]amino]benzoate Openeye Name: 4-[[(5S)-5-ethoxycarbonyl-5-methyl-2-oxo-1-phenyl-pyrrol-3-yl]amino]benzoate CAS Name: 4-[[(5S)-5-ethoxycarbonyl-5-methyl-2-oxo-1-phenyl-3-pyrrolyl]amino]benzoate IUPAC Name: 4-[[(5S)-5-ethoxycarbonyl-5-methyl-2-oxo-1-phenylpyrrol-3-yl]amino]benzoate Traditional Name: 4-[[(5S)-5-carbethoxy-2-keto-5-methyl-1-phenyl-3-pyrrolin-3-yl]amino]benzoate Formula: C21H19N2O5- MolecularWeight: 379.38596

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C=C(C(=O)N1C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)[O-])C

Isomeric SMILES

CCOC(=O)[C@@]1(C=C(C(=O)N1C2=CC=CC=C2)NC3=CC=C(C=C3)C(=O)[O-])C

InChI

InChI=1S/C21H20N2O5/c1-3-28-20(27)21(2)13-17(18(24)23(21)16-7-5-4-6-8-16)22-15-11-9-14(10-12-15)19(25)26/h4-13,22H,3H2,1-2H3,(H,25,26)/p-1/t21-/m0/s1